(1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol

C19H24N4O3 — CID 1111790

IUPAC(1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol
SMILES[H]/N=c1\n(CCN2CCOCC2)c2ccccc2n1C[C@@H](O)c1ccco1
InChIInChI=1S/C19H24N4O3/c20-19-22(8-7-21-9-12-25-13-10-21)15-4-1-2-5-16(15)23(19)14-17(24)18-6-3-11-26-18/h1-6,11,17,20,24H,7-10,12-14H2/b20-19+/t17-/m1/s1
InChIKeyNNEIBXZREJEQDQ-NHKNDPDJSA-N
MW356.43 g/mol
LogP1.58
Rot. Bonds6

About (1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol

(1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol (PubChem CID 1111790) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is (1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol
PubChem CID1111790
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Name(1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol
SMILES[H]/N=c1\n(CCN2CCOCC2)c2ccccc2n1C[C@@H](O)c1ccco1
InChIInChI=1S/C19H24N4O3/c20-19-22(8-7-21-9-12-25-13-10-21)15-4-1-2-5-16(15)23(19)14-17(24)18-6-3-11-26-18/h1-6,11,17,20,24H,7-10,12-14H2/b20-19+/t17-/m1/s1
InChIKeyNNEIBXZREJEQDQ-NHKNDPDJSA-N
XLogP1.58
TPSA79.55 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze (1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol with MolForge

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Related Compounds

1-(furan-2-yl)-2-[2-imino-3-(2-piperidin-1-ylethyl)benzimidazol-1-yl]ethanol
CID 3130803
1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanone;hydrobromide
CID 2881509
diethyl-[2-[3-[2-(furan-2-yl)-2-hydroxyethyl]-2-iminobenzimidazol-1-yl]ethyl]azanium chloride
CID 44658221
(2S)-1-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]-3-phenoxypropan-2-ol
CID 1118371
2-[2-imino-3-(2-piperidin-1-ylethyl)benzimidazol-1-yl]-1-phenylethanol
CID 2868077
2-[3-[(2-chlorophenyl)methyl]-2-iminobenzimidazol-1-yl]-1-(furan-2-yl)ethanol
CID 2881416
1-(2-morpholin-4-ylethyl)-3-(2-phenylethyl)benzimidazol-2-imine;hydrobromide
CID 163329418
hydron;1-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]-3-(4-methylphenoxy)propan-2-ol;chloride
CID 655595
2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]-1-(4-methylphenyl)ethanone
CID 1125264
1-(3,4-dichlorophenyl)-2-[2-imino-3-(2-piperidin-1-ylethyl)benzimidazol-1-yl]ethanol chloride
CID 53346962
1-[2-(4-methylphenoxy)ethyl]-3-(2-morpholin-4-ylethyl)benzimidazol-2-imine
CID 1259026
4-[2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]acetyl]benzonitrile;hydrobromide
CID 163331898

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol?
The IUPAC name of (1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol (CID 1111790) is (1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol.
What is the SMILES notation for (1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol?
The canonical SMILES for (1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol is [H]/N=c1\n(CCN2CCOCC2)c2ccccc2n1C[C@@H](O)c1ccco1.
What is the InChIKey of (1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol?
The InChIKey is NNEIBXZREJEQDQ-NHKNDPDJSA-N. The full InChI is InChI=1S/C19H24N4O3/c20-19-22(8-7-21-9-12-25-13-10-21)15-4-1-2-5-16(15)23(19)14-17(24)18-6-3-11-26-18/h1-6,11,17,20,24H,7-10,12-14H2/b20-19+/t17-/m1/s1.
What are the key properties of (1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol?
(1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol has a molecular weight of 356.43 g/mol, XLogP of 1.58, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(furan-2-yl)-2-[2-imino-3-(2-morpholin-4-ylethyl)benzimidazol-1-yl]ethanol is sourced from PubChem (CID 1111790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).